Spinosyn U

スピノシンU

Decided structure
Molecular formula： C₃₉H₆₁NO₁₀
Molecular formula furigana： C39-H61-N-O10
Molecular weight： 703.914

InChI： InChI=1S/C39H61NO10/c1-8-24-10-9-11-32(50-34-15-14-31(40(5)6)21(3)46-34)20(2)35(42)30-18-28-26(29(30)19-33(41)48-24)13-12-23-16-25(17-27(23)28)49-39-37(44)38(45-7)36(43)22(4)47-39/h12-13,18,20-29,31-32,34,36-39,43-44H,8-11,14-17,19H2,1-7H3/t20-,21-,22+,23-,24+,25-,26-,27-,28-,29+,31+,32+,34+,36+,37-,38-,39+/m1/s1

InChI key： ULTZOJCLIRDVLW-PNXRJMMDSA-N

SMILES： CC[C@H]1CCC[C@H](O[C@H]2CC[C@@H]([C@@H](C)O2)N(C)C)[C@@H](C)C(=O)C2=C[C@H]3[C@@H]4C[C@@H](C[C@H]4C=C[C@H]3[C@@H]2CC(=O)O1)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](OC)[C@H]1O

Systematic name (3)：

(1R,17R)-8β-エチル-12α-[5α-(ジメチルアミノ)-6β-メチルテトラヒドロ-2H-ピラン-2β-イルオキシ]-13β-メチル-17-(3-O-メチル-α-L-ラムノピラノシルオキシ)-1α,2β-プロパノ-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-テトラデカヒドロ-7-オキサ-7H-シクロドデカ[a]インデン-6,14-ジオン
(2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-2-{[(2R,3R,4R,5S,6S)-3,5-ジヒドロキシ-4-メトキシ-6-メチルオキサン-2-イル]オキシ}-13-{[(2R,5S,6R)-5-(ジメチルアミノ)-6-メチルオキサン-2-イル]オキシ}-9-エチル-14-メチル-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-as-インダセノ[3,2-d]オキサシクロドデカン-7,15-ジオン
(2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-2-{[(2R,3R,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-as-indaceno[3,2-d]oxacyclododecane-7,15-dione

Other name (3)：

(1R,17R)-8β-Ethyl-12α-[5α-(dimethylamino)-6β-methyltetrahydro-2H-pyran-2β-yloxy]-13β-methyl-17-(3-O-methyl-α-L-rhamnopyranosyloxy)-1α,2β-propano-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-tetradecahydro-7-oxa-7H-cyclododeca[a]indene-6,14-dione
スピノシンU
Spinosyn U

Thsaurus map：

Thesaurus Map

Return to Previous Page